Cas no 41394-95-0 (2-(Isopropylsulfanyl)benzoic acid)

2-(Isopropylsulfanyl)benzoic acid structure
41394-95-0 structure
Product Name:2-(Isopropylsulfanyl)benzoic acid
CAS No:41394-95-0
MF:C10H12O2S
MW:196.266081809998
MDL:MFCD07364761
CID:1513249
PubChem ID:4777955
Update Time:2025-04-21

2-(Isopropylsulfanyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-propan-2-ylsulfanylbenzoic acid
    • SureCN3309695
    • 2-isopropylthiobenzoic acid
    • AC1Q1QU1
    • AC1NGPF1
    • (2-isopropylthio)benzoic acid
    • 2-Isopropylmercapto-benzoesaeure
    • 2-(methylethylthio)benzoic acid
    • ACMC-209jk6
    • 2-isopropylsulfanylbenzoic acid
    • 2-isopropylsulfanyl-benzoic acid
    • 2-(propan-2-ylsulfanyl)benzoic acid
    • 2-(Isopropylsulfanyl)benzoic acid
    • 2-(isopropylthio)benzoic acid
    • 2-isopropylmercaptobenzoic acid
    • STK288483
    • 41394-95-0
    • AKOS000172909
    • ALBB-009440
    • AT22923
    • VS-00595
    • CS-0452276
    • BBL000366
    • DTXSID50406477
    • AB01331885-02
    • CHFNTLOTIFQVGQ-UHFFFAOYSA-N
    • SCHEMBL3309695
    • EN300-22333
    • MFCD07364761
    • Z147642722
    • Benzoic acid, 2-[(1-methylethyl)thio]-
    • 2-(Isopropylsulfanyl)benzoicacid
    • NCGC00339303-01
    • MDL： MFCD07364761
    • Inchi： 1S/C10H12O2S/c1-7(2)13-9-6-4-3-5-8(9)10(11)12/h3-7H,1-2H3,(H,11,12)
    • InChI Key： CHFNTLOTIFQVGQ-UHFFFAOYSA-N
    • SMILES： S(C1C=CC=CC=1C(=O)O)C(C)C

Computed Properties

  • Exact Mass: 196.05600
  • Monoisotopic Mass: 196.05580079g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 180
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 62.6?2

Experimental Properties

  • PSA: 62.60000
  • LogP: 2.88530

2-(Isopropylsulfanyl)benzoic acid Customs Data

  • HS CODE：2930909090
  • Customs Data：

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

2-(Isopropylsulfanyl)benzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Matrix Scientific
040426-500mg
2-(Isopropylthio)benzoic acid
 41394-95-0
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 $152.00 2023-09-11
TRC
I873493-100mg
2-(Isopropylsulfanyl)benzoic acid
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 $64.00 2023-05-18
TRC
I873493-250mg
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 $75.00 2023-05-18
TRC
I873493-500mg
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 $87.00 2023-05-18
TRC
I873493-1g
2-(Isopropylsulfanyl)benzoic acid
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 $98.00 2023-05-18
Apollo Scientific
OR908021-1g
2-(Isopropylsulfanyl)benzoic acid
 41394-95-0 98%
1g
 ￡90.00 2025-02-20
Apollo Scientific
OR908021-5g
2-(Isopropylsulfanyl)benzoic acid
 41394-95-0 98%
5g
 ￡185.00 2025-02-20
Apollo Scientific
OR908021-25g
2-(Isopropylsulfanyl)benzoic acid
 41394-95-0 98%
25g
 ￡445.00 2025-02-20
SHANG HAI XIAN DING Biotechnology Co., Ltd.
040426-500mg
2-(Isopropylthio)benzoic acid
 41394-95-0
500mg
 535.0CNY 2021-07-07
abcr
AB369694-500 mg
2-(Propan-2-ylsulfanyl)benzoic acid
 41394-95-0
500MG
 €195.40 2023-01-15

2-(Isopropylsulfanyl)benzoic acid Production Method

2-(Isopropylsulfanyl)benzoic acid Related Literature

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